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Chemical ID: 6006196

CCN(CC(=O)N1CC(=O)N(C1)c2ccc(cc2)Cl)C(=O)Cc3ccc(cc3)OC

Chemical ID:

6006196

Name [?]:

N-[[3-(4-chlorophenyl)-4-oxo-imidazolidin-1-yl]carbonylmethyl]-N-ethyl-2-(4-methoxyphenyl)-acetamide

SMILES [?]:

CCN(CC(=O)N1CC(=O)N(C1)c2ccc(cc2)Cl)C(=O)Cc3ccc(cc3)OC

InChi [?]:

InChI=1/C22H24ClN3O4/c1-3-24(20(27)12-16-4-10-19(30-2)11-5-16)13-21(28)25-14-22(29)26(15-25)18-8-6-17(23)7-9-18/h4-11H,3,12-15H2,1-2H3

InChi Info:

AuxInfo=1/0/N:1,30,2,24,28,15,17,14,18,25,27,22,4,8,12,23,16,13,26,20,5,9,19,3,7,11,21,6,10,29/E:(4,5)(6,7)(8,9)(10,11)/rA:30nCCNCCONCCONCCCCCCCClCOCCCCCCCOC/rB:s1;s2;s3;s4;d5;s5;s7;s8;d9;s9;s7s11;s11;s13;d14;s15;d16;d13s17;s16;s3;d20;s20;s22;s23;d24;s25;d26;d23s27;s26;s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₂H₂₄ClN₃O₄
All Atoms:	30
Heavy Atoms:	30
Chiral Atoms:	0

ZAP Information [?]

Total:	10.6781
Area:	675.033
Solvation:	-6.19774
Coulombic:	-55.6161

Bond Count [?]

All:	32
Single:	23
Double:	9
Rotors:	9
Chiral:	0
Rigid Segments:	7

Chemical Properties

Molecular Weight:	429.896
H-Bond Donors:	0
H-Bond Acceptors:	7
XLogP:	2.46
LogP (Chemaxon):	2.12

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical Mix	Source	External ID	Descriptor	Value